[AMBER] cpptraj hbond analysis cutoff angle

From: DEBOSTUTI GHOSHDASTIDAR <debostutighosh.gmail.com>
Date: Sat, 29 Mar 2014 11:07:22 +0530

Hi

I am trying to disable the angle cutoff in cpptraj hbond analysis but the
job is not running when I do that.

My command line is:

hbond W_W out wat_wat_nocut.dat :WAT angle -1.0 dist 3.5 avgout
wat_wat_avg_nocut.dat


Can anybody help me with what's going wrong?

Thanks
-- 
Debostuti
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Received on Fri Mar 28 2014 - 23:00:02 PDT
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